N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide

C11H17N3O2S — CID 164638799

IUPACN,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)N(C)CC[C@H]1CCCO1
InChIInChI=1S/C11H17N3O2S/c1-8-10(17-13-12-8)11(15)14(2)6-5-9-4-3-7-16-9/h9H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyWTEMZPXETWJTLY-SECBINFHSA-N
MW255.34 g/mol
LogP1.49
Rot. Bonds4

About N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide

N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide (PubChem CID 164638799) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide
PubChem CID164638799
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC NameN,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide
SMILESCc1nnsc1C(=O)N(C)CC[C@H]1CCCO1
InChIInChI=1S/C11H17N3O2S/c1-8-10(17-13-12-8)11(15)14(2)6-5-9-4-3-7-16-9/h9H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyWTEMZPXETWJTLY-SECBINFHSA-N
XLogP1.49
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide?
The IUPAC name of N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide (CID 164638799) is N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide.
What is the SMILES notation for N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide?
The canonical SMILES for N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide is Cc1nnsc1C(=O)N(C)CC[C@H]1CCCO1.
What is the InChIKey of N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide?
The InChIKey is WTEMZPXETWJTLY-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-8-10(17-13-12-8)11(15)14(2)6-5-9-4-3-7-16-9/h9H,3-7H2,1-2H3/t9-/m1/s1.
What are the key properties of N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide?
N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide has a molecular weight of 255.34 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[2-[(2R)-oxolan-2-yl]ethyl]thiadiazole-5-carboxamide is sourced from PubChem (CID 164638799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).